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2-Butanone, 4-(4-bromophenyl)-4-hydroxy-3-methyl-, (R*,S*)-
SpectraBase Compound ID NAKZO6k4tY
InChI InChI=1S/C11H13BrO2/c1-7(8(2)13)11(14)9-3-5-10(12)6-4-9/h3-7,11,14H,1-2H3/t7-,11-/m1/s1
InChIKey FSNZIXBQKYOTLP-RDDDGLTNSA-N
Mol Weight 257.13 g/mol
Molecular Formula C11H13BrO2
Exact Mass 256.009893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8l2nYUkTua
Name 2-Butanone, 4-(4-bromophenyl)-4-hydroxy-3-methyl-, (R*,S*)-
CAS Registry Number 119751-98-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13BrO2
InChI InChI=1S/C11H13BrO2/c1-7(8(2)13)11(14)9-3-5-10(12)6-4-9/h3-7,11,14H,1-2H3/t7-,11-/m1/s1
InChIKey FSNZIXBQKYOTLP-RDDDGLTNSA-N
Molecular Weight 257.127 g/mol
SMILES O[C@]([C@@](C(=O)C)(C)[H])(c1ccc(cc1)Br)[H]
SPLASH splash10-000f-0090000000-6ac6bbe3928bbaeb4a4c
Source of Spectrum KC-1988-2858-3
Synonyms (3S,4R)-4-(4-bromophenyl)-4-hydroxy-3-methyl-2-butanone Threo-4-(4-bromophenyl)-4-hydroxy-3-methylbutan-2-one
Wiley ID 1259278